#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1ibl n SER 17 N 0.00 -7.37 -2.82 3.54 2.88 -1.26 -5.02 113.62 103.57 1ibl n SER 17 Ca 0.00 0.55 -0.11 0.00 -1.33 0.00 0.00 58.87 57.98 1ibl n SER 17 Cb 0.00 -4.96 0.03 0.00 -0.75 0.00 0.00 64.21 58.54 1ibl n SER 17 CO 0.00 0.00 0.00 0.54 -1.23 0.00 0.00 175.04 174.35 1ibl n ARG 18 N -0.24 1.09 0.00 -1.46 5.12 -1.26 -5.07 116.66 114.84 1ibl n ARG 18 Ca 0.10 -2.92 0.00 0.00 -1.93 0.00 0.00 57.85 53.09 1ibl n ARG 18 Cb 0.38 -1.15 0.00 0.00 -1.16 0.00 0.00 32.46 30.53 1ibl n ARG 18 CO 0.00 0.00 0.00 1.63 -1.93 0.00 0.00 177.63 177.33 1ibl n LYS 19 N -0.02 0.00 -4.20 5.56 4.01 -1.26 -5.17 118.16 117.09 1ibl n LYS 19 Ca 0.11 0.00 -0.26 0.00 -0.51 0.00 0.00 58.31 57.65 1ibl n LYS 19 Cb 0.77 0.00 -0.06 0.00 -0.51 0.00 0.00 35.03 35.23 1ibl n LYS 19 CO 0.00 0.00 0.00 0.00 -1.11 0.00 0.00 177.40 176.29 1ibl s ALA 20 N -2.00 3.81 0.00 7.82 0.00 -1.26 -5.14 121.76 124.99 1ibl s ALA 20 Ca 0.00 -1.69 0.05 0.00 0.00 0.00 0.00 51.96 50.32 1ibl s ALA 20 Cb 0.00 -0.36 -0.03 0.00 0.00 0.00 0.00 23.12 22.73 1ibl s ALA 20 CO 0.00 -0.20 -0.16 0.15 0.00 0.00 0.00 175.76 175.55 1ibl s LYS 21 N -3.97 2.29 0.19 0.00 3.01 -1.26 -4.95 119.74 115.05 1ibl s LYS 21 Ca 0.34 -0.85 0.06 0.00 -1.01 0.00 0.00 55.97 54.51 1ibl s LYS 21 Cb 0.03 -2.29 0.30 0.00 -1.01 0.00 0.00 37.83 34.86 1ibl s LYS 21 CO 0.19 0.58 0.97 0.28 0.51 0.00 0.00 175.35 177.88 1ibl n VAL 22 N 1.86 0.63 -0.08 3.17 0.31 -1.12 0.12 118.33 123.23 1ibl n VAL 22 Ca -0.16 0.64 -0.23 0.00 -0.01 0.00 0.00 64.34 64.58 1ibl n VAL 22 Cb 0.52 -1.64 -0.12 0.00 -0.91 0.00 0.00 33.84 31.69 1ibl n VAL 22 CO 0.00 0.00 0.00 1.17 -1.32 0.00 0.00 176.83 176.68 1ibl n LYS 23 N -1.65 0.65 0.32 5.55 4.81 -1.21 -4.45 118.16 122.18 1ibl n LYS 23 Ca -0.00 0.33 -0.18 0.00 -0.87 0.00 0.00 58.31 57.58 1ibl n LYS 23 Cb 0.37 -1.63 -0.09 0.00 0.02 0.00 0.00 35.03 33.69 1ibl n LYS 23 CO 0.00 0.00 0.00 0.00 1.17 0.00 0.00 177.40 178.57 1ibl h ALA 24 N -0.33 -1.03 -0.48 3.14 0.00 -0.64 -3.13 119.26 116.80 1ibl h ALA 24 Ca -0.50 -0.19 -0.60 0.00 0.00 0.00 0.00 54.91 53.63 1ibl h ALA 24 Cb 1.72 0.59 -0.05 0.00 0.00 0.00 0.00 17.79 20.05 1ibl h ALA 24 CO -0.14 -1.11 2.14 2.41 0.00 0.00 0.00 179.25 182.55 1ibl n THR 25 N -5.54 3.09 0.00 0.00 -1.04 -0.69 -4.67 114.28 105.43 1ibl n THR 25 Ca -0.12 -3.06 0.00 0.00 -2.04 0.00 0.00 64.05 58.83 1ibl n THR 25 Cb 0.44 -2.36 0.00 0.00 -1.82 0.00 0.00 70.33 66.59 1ibl n THR 25 CO 0.00 0.00 0.00 -0.11 -0.64 0.00 0.00 175.07 174.32 1ibl n LEU 26 N 9.27 0.00 0.00 -4.42 7.94 -1.18 -4.83 117.00 123.78 1ibl n LEU 26 Ca 0.49 0.00 0.00 0.00 -1.11 0.00 0.00 56.01 55.39 1ibl n LEU 26 Cb 0.44 0.00 0.00 0.00 0.53 0.00 0.00 43.42 44.39 1ibl n LEU 26 CO 0.81 0.00 0.00 0.61 -1.11 0.00 0.00 177.39 177.70 1ibl n GLY 27 N -0.98 1.93 3.84 -3.96 0.00 -1.26 -4.95 105.19 99.81 1ibl n GLY 27 Ca 0.00 0.00 -0.34 0.00 0.00 0.00 0.00 46.02 45.68 1ibl n GLY 27 CO 0.00 0.00 0.00 -1.83 0.00 0.00 0.00 173.32 171.49 1ibl s GLU 28 N 3.74 4.06 -0.05 1.61 -1.05 -1.26 -5.03 118.70 120.72 1ibl s GLU 28 Ca 0.00 0.64 -0.29 0.00 -0.15 0.00 0.00 54.97 55.17 1ibl s GLU 28 Cb 0.00 -2.76 0.10 0.00 -0.44 0.00 0.00 34.13 31.03 1ibl s GLU 28 CO 0.00 0.35 0.86 -0.59 0.95 0.00 0.00 175.26 176.83 1ibl s PHE 29 N -1.65 -0.43 -0.58 4.83 -0.12 -1.26 -5.12 117.98 113.65 1ibl s PHE 29 Ca 0.45 0.53 -0.23 0.00 -0.05 0.00 0.00 56.93 57.63 1ibl s PHE 29 Cb -0.14 0.49 0.05 0.00 -0.63 0.00 0.00 43.02 42.79 1ibl s PHE 29 CO 0.20 -0.52 0.93 0.34 -0.05 0.00 0.00 175.22 176.12 1ibl s ASP 30 N -1.81 6.28 0.59 1.98 2.15 -1.26 -4.87 116.67 119.72 1ibl s ASP 30 Ca -0.01 -0.57 0.29 0.00 0.43 0.00 0.00 52.55 52.69 1ibl s ASP 30 Cb -0.01 -2.42 1.65 0.00 -0.30 0.00 0.00 42.92 41.84 1ibl s ASP 30 CO -0.02 -1.27 2.10 -0.07 -0.17 0.00 0.00 175.17 175.73 1ibl h LEU 31 N 11.02 0.00 0.00 -1.34 3.38 -1.99 0.22 115.31 126.60 1ibl h LEU 31 Ca -0.27 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.70 1ibl h LEU 31 Cb 1.07 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.82 1ibl h LEU 31 CO 1.11 0.00 -0.34 -1.14 0.09 0.00 0.00 178.44 178.16 1ibl n ARG 32 N -3.81 0.17 -2.26 1.13 0.63 -1.26 -4.53 116.66 106.72 1ibl n ARG 32 Ca 0.02 0.08 -0.41 0.00 -0.92 0.00 0.00 57.85 56.62 1ibl n ARG 32 Cb 0.33 -1.64 -0.03 0.00 0.45 0.00 0.00 32.46 31.57 1ibl n ARG 32 CO 0.00 0.00 0.00 0.34 -2.51 0.00 0.00 177.63 175.46 1ibl s ASP 33 N -3.82 5.93 0.00 6.15 2.15 0.06 -4.84 116.67 122.30 1ibl s ASP 33 Ca 0.10 0.47 0.27 0.00 0.43 0.00 0.00 52.55 53.81 1ibl s ASP 33 Cb 0.15 -2.54 1.32 0.00 -0.30 0.00 0.00 42.92 41.55 1ibl s ASP 33 CO 0.65 -1.83 1.88 0.00 -0.17 0.00 0.00 175.17 175.70 1ibl n TYR 34 N 10.29 0.03 -0.00 -5.34 0.18 -1.26 -3.65 117.16 117.41 1ibl n TYR 34 Ca 0.16 -0.02 0.08 0.00 1.88 0.00 0.00 57.90 60.00 1ibl n TYR 34 Cb 0.49 0.00 -0.12 0.00 -0.38 0.00 0.00 39.34 39.33 1ibl n TYR 34 CO 0.00 0.00 0.00 0.54 -2.08 0.00 0.00 176.86 175.32 1ibl n ARG 35 N -0.40 0.49 -0.65 -3.48 1.74 -1.26 -4.19 116.66 108.92 1ibl n ARG 35 Ca 0.19 -0.14 -0.23 0.00 -0.77 0.00 0.00 57.85 56.90 1ibl n ARG 35 Cb 0.21 -1.38 -0.03 0.00 -1.02 0.00 0.00 32.46 30.25 1ibl n ARG 35 CO 0.00 0.00 0.00 -1.71 -1.52 0.00 0.00 177.63 174.40 1ibl n ASN 36 N -2.05 3.20 -0.33 0.55 4.05 -1.24 -4.61 115.26 114.83 1ibl n ASN 36 Ca -0.03 -2.34 0.17 0.00 0.45 0.00 0.00 54.58 52.84 1ibl n ASN 36 Cb 0.41 -0.94 0.38 0.00 1.23 0.00 0.00 39.78 40.86 1ibl n ASN 36 CO 0.00 0.00 0.00 0.58 -3.05 0.00 0.00 177.26 174.79 1ibl h VAL 37 N 3.85 0.46 -0.56 3.44 2.07 -1.89 -1.25 116.25 122.38 1ibl h VAL 37 Ca 0.36 -0.16 0.07 0.00 0.82 0.00 0.00 66.70 67.79 1ibl h VAL 37 Cb 0.26 -0.04 -0.10 0.00 -1.52 0.00 0.00 31.29 29.89 1ibl h VAL 37 CO 1.49 0.09 -0.51 -0.33 0.02 0.00 0.00 177.57 178.33 1ibl h GLU 38 N 0.47 -0.27 0.00 1.57 4.39 -1.99 -0.41 114.58 118.35 1ibl h GLU 38 Ca 0.64 0.02 -0.17 0.00 0.34 0.00 0.00 59.36 60.18 1ibl h GLU 38 Cb 1.26 0.06 -0.03 0.00 -0.10 0.00 0.00 28.75 29.95 1ibl h GLU 38 CO -0.52 -0.18 -1.01 -0.24 -1.16 0.00 0.00 179.01 175.90 1ibl h VAL 39 N -0.28 0.96 -0.54 3.13 3.04 -1.82 -3.32 116.25 117.43 1ibl h VAL 39 Ca 0.13 -2.50 -0.01 0.00 -1.01 0.00 0.00 66.70 63.31 1ibl h VAL 39 Cb 0.56 2.42 -0.03 0.00 -2.01 0.00 0.00 31.29 32.23 1ibl h VAL 39 CO -0.68 0.55 0.30 -0.07 -1.01 0.00 0.00 177.57 176.66 1ibl h LEU 40 N 0.00 0.66 -0.64 3.16 3.38 -0.78 -2.41 115.31 118.69 1ibl h LEU 40 Ca -0.08 -0.08 0.13 0.00 0.09 0.00 0.00 57.88 57.93 1ibl h LEU 40 Cb 1.61 -0.17 -0.12 0.00 0.09 0.00 0.00 40.66 42.07 1ibl h LEU 40 CO 0.08 0.55 -0.20 0.11 0.09 0.00 0.00 178.44 179.07 1ibl h LYS 41 N 0.72 -0.04 -1.86 1.13 1.57 -1.18 0.16 116.57 117.06 1ibl h LYS 41 Ca 0.19 0.00 0.54 0.00 -1.87 0.00 0.00 60.65 59.51 1ibl h LYS 41 Cb 0.03 0.01 -0.07 0.00 0.08 0.00 0.00 32.23 32.28 1ibl h LYS 41 CO -0.03 -0.03 1.35 0.00 -0.57 0.00 0.00 179.45 180.17 1ibl h ARG 42 N -0.04 0.00 -0.29 3.15 2.47 -1.57 0.59 114.38 118.69 1ibl h ARG 42 Ca 0.30 0.00 0.00 0.00 -1.26 0.00 0.00 59.98 59.02 1ibl h ARG 42 Cb 0.50 0.00 0.00 0.00 -1.65 0.00 0.00 29.97 28.82 1ibl h ARG 42 CO -0.68 0.00 0.00 1.19 0.56 0.00 0.00 179.97 181.04 1ibl n PHE 43 N -3.95 0.38 -4.08 3.04 3.01 0.56 -4.86 117.46 111.57 1ibl n PHE 43 Ca 0.42 -0.19 -0.26 0.00 1.01 0.00 0.00 57.45 58.43 1ibl n PHE 43 Cb 1.91 0.00 -0.05 0.00 -0.01 0.00 0.00 39.48 41.33 1ibl n PHE 43 CO 0.00 0.00 0.00 -0.51 1.01 0.00 0.00 176.76 177.26 1ibl s LEU 44 N -1.02 3.82 0.00 4.37 1.43 0.21 -1.62 118.68 125.88 1ibl s LEU 44 Ca 0.20 -0.14 -0.12 0.00 -1.03 0.00 0.00 54.13 53.04 1ibl s LEU 44 Cb 0.10 -2.42 0.17 0.00 0.03 0.00 0.00 46.19 44.07 1ibl s LEU 44 CO 0.14 0.05 0.79 -1.54 0.23 0.00 0.00 176.35 176.02 1ibl n SER 45 N -0.46 -0.77 0.09 2.29 3.41 0.40 -4.80 113.62 113.77 1ibl n SER 45 Ca -0.08 -1.13 0.06 0.00 -0.26 0.00 0.00 58.87 57.45 1ibl n SER 45 Cb 0.55 -0.65 0.30 0.00 -0.26 0.00 0.00 64.21 64.15 1ibl n SER 45 CO 0.00 0.00 0.00 -0.62 -0.16 0.00 0.00 175.04 174.26 1ibl n GLU 46 N -3.22 0.07 -4.37 4.33 4.71 -1.26 -4.29 120.64 116.61 1ibl n GLU 46 Ca 0.10 0.55 -0.23 0.00 -0.01 0.00 0.00 57.16 57.58 1ibl n GLU 46 Cb 0.38 -1.78 -0.11 0.00 -1.01 0.00 0.00 31.44 28.91 1ibl n GLU 46 CO 0.00 0.00 0.00 0.99 0.09 0.00 0.00 177.13 178.21 1ibl s THR 47 N -3.25 2.00 -1.28 2.62 2.01 -1.26 -4.78 115.64 111.69 1ibl s THR 47 Ca -0.01 -2.00 0.00 0.00 0.31 0.00 0.00 61.69 59.99 1ibl s THR 47 Cb 0.03 -1.96 0.00 0.00 0.01 0.00 0.00 72.50 70.58 1ibl s THR 47 CO 0.10 -0.29 0.07 0.61 -0.69 0.00 0.00 174.62 174.42 1ibl n GLY 48 N 0.18 0.00 3.75 4.40 0.00 -1.26 -4.72 105.19 107.54 1ibl n GLY 48 Ca -0.12 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.49 1ibl n GLY 48 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1ibl s LYS 49 N -1.36 4.52 -0.04 1.61 1.02 -1.26 -4.64 119.74 119.58 1ibl s LYS 49 Ca 0.00 1.94 -0.30 0.00 0.02 0.00 0.00 55.97 57.63 1ibl s LYS 49 Cb 0.00 -3.17 -0.06 0.00 -0.52 0.00 0.00 37.83 34.08 1ibl s LYS 49 CO 0.00 0.01 1.61 0.42 -0.92 0.00 0.00 175.35 176.47 1ibl s ILE 50 N -0.80 3.58 0.77 2.17 1.01 -1.26 -0.46 121.20 126.21 1ibl s ILE 50 Ca 0.48 0.76 -0.15 0.00 0.00 0.00 0.00 60.65 61.75 1ibl s ILE 50 Cb -0.34 -3.49 0.06 0.00 0.01 0.00 0.00 42.46 38.70 1ibl s ILE 50 CO 0.43 -0.06 1.22 0.18 0.00 0.00 0.00 174.94 176.71 1ibl n LEU 51 N 6.82 4.82 -4.79 2.97 4.77 -0.64 -4.88 117.00 126.08 1ibl n LEU 51 Ca 0.17 0.65 -0.35 0.00 -0.03 0.00 0.00 56.01 56.44 1ibl n LEU 51 Cb 0.43 -1.52 -0.05 0.00 -2.33 0.00 0.00 43.42 39.95 1ibl n LEU 51 CO 0.62 -1.53 0.70 -2.84 -1.33 0.00 0.00 177.39 173.01 1ibl s PRO 52 N -3.90 4.18 0.54 3.23 0.02 -1.26 -4.81 135.00 133.00 1ibl s PRO 52 Ca 0.76 1.37 0.25 0.00 0.02 0.00 0.00 61.00 63.40 1ibl s PRO 52 Cb -0.32 -2.43 1.43 0.00 0.02 0.00 0.00 34.50 33.20 1ibl s PRO 52 CO 0.48 -0.10 2.04 -0.09 -0.33 0.00 0.00 177.00 179.00 1ibl h ARG 53 N 2.33 0.00 -1.18 5.54 2.43 -1.93 0.44 114.38 122.01 1ibl h ARG 53 Ca -0.48 0.00 0.34 0.00 -0.81 0.00 0.00 59.98 59.02 1ibl h ARG 53 Cb 1.20 0.00 -0.09 0.00 -0.42 0.00 0.00 29.97 30.67 1ibl h ARG 53 CO 0.62 0.00 0.79 0.00 -1.51 0.00 0.00 179.97 179.86 1ibl h ARG 54 N 0.00 0.20 0.00 0.20 3.08 -1.93 -2.14 114.38 113.80 1ibl h ARG 54 Ca 0.18 -0.01 0.00 0.00 0.07 0.00 0.00 59.98 60.21 1ibl h ARG 54 Cb 0.76 -0.05 0.00 0.00 0.08 0.00 0.00 29.97 30.76 1ibl h ARG 54 CO -0.00 0.13 0.00 0.54 -1.07 0.00 0.00 179.97 179.57 1ibl n ARG 55 N -4.50 0.36 0.00 0.04 1.74 0.13 -4.55 116.66 109.88 1ibl n ARG 55 Ca 0.29 -0.30 0.13 0.00 -0.77 0.00 0.00 57.85 57.19 1ibl n ARG 55 Cb 1.14 -0.78 0.30 0.00 -1.02 0.00 0.00 32.46 32.10 1ibl n ARG 55 CO 0.00 0.00 0.00 0.25 -1.52 0.00 0.00 177.63 176.36 1ibl n THR 56 N -0.14 0.00 0.00 0.55 -2.24 0.12 -2.79 114.28 109.79 1ibl n THR 56 Ca 0.00 -0.15 0.00 0.00 -2.27 0.00 0.00 64.05 61.63 1ibl n THR 56 Cb 0.05 0.55 0.00 0.00 -2.10 0.00 0.00 70.33 68.84 1ibl n THR 56 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 1ibl n GLY 57 N 1.36 1.10 0.00 3.38 0.00 -0.84 -3.35 105.19 106.85 1ibl n GLY 57 Ca 0.11 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.13 1ibl n GLY 57 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 173.32 174.36 1ibl n LEU 58 N 0.00 0.00 -4.35 0.99 4.77 -1.26 -4.99 117.00 112.16 1ibl n LEU 58 Ca 0.00 0.00 -0.18 0.00 -0.03 0.00 0.00 56.01 55.80 1ibl n LEU 58 Cb 0.00 0.00 -0.10 0.00 -2.33 0.00 0.00 43.42 40.99 1ibl n LEU 58 CO 0.00 -1.02 -0.38 -0.94 -1.33 0.00 0.00 177.39 173.72 1ibl s SER 59 N -1.98 2.29 0.19 -1.43 1.04 -1.26 -4.85 113.70 107.70 1ibl s SER 59 Ca 0.00 -1.12 -0.21 0.00 0.48 0.00 0.00 55.95 55.09 1ibl s SER 59 Cb 0.00 -0.08 0.11 0.00 0.10 0.00 0.00 66.02 66.15 1ibl s SER 59 CO 0.00 -0.34 1.45 0.61 0.98 0.00 0.00 173.24 175.94 1ibl n GLY 60 N -0.42 -2.13 0.07 7.32 0.00 -1.26 0.18 105.19 108.94 1ibl n GLY 60 Ca -0.07 1.08 -0.13 0.00 0.00 0.00 0.00 46.02 46.90 1ibl n GLY 60 CO 0.00 0.00 0.00 1.70 0.00 0.00 0.00 173.32 175.02 1ibl h LYS 61 N 0.00 -0.05 0.17 1.61 3.64 -1.99 -1.91 116.57 118.04 1ibl h LYS 61 Ca 0.26 0.00 -0.01 0.00 -1.27 0.00 0.00 60.65 59.63 1ibl h LYS 61 Cb 0.49 0.01 0.00 0.00 -0.41 0.00 0.00 32.23 32.33 1ibl h LYS 61 CO -0.91 0.22 -0.08 0.93 -2.27 0.00 0.00 179.45 177.34 1ibl h GLU 62 N -0.33 -0.22 -0.98 1.90 5.08 -1.57 -2.43 114.58 116.04 1ibl h GLU 62 Ca -0.01 0.01 0.26 0.00 -1.00 0.00 0.00 59.36 58.63 1ibl h GLU 62 Cb 0.30 0.05 -0.06 0.00 0.50 0.00 0.00 28.75 29.54 1ibl h GLU 62 CO 0.01 0.02 0.67 0.37 -1.00 0.00 0.00 179.01 179.07 1ibl h GLN 63 N -0.43 0.21 -0.34 2.33 5.75 0.18 0.85 115.11 123.66 1ibl h GLN 63 Ca -0.02 -0.01 -0.09 0.00 -0.15 0.00 0.00 58.65 58.38 1ibl h GLN 63 Cb 0.33 -0.05 -0.01 0.00 1.07 0.00 0.00 27.48 28.83 1ibl h GLN 63 CO 0.04 0.14 -0.13 -0.09 -2.65 0.00 0.00 178.83 176.13 1ibl h ARG 64 N 0.21 0.69 -0.33 1.69 2.43 -0.87 -2.55 114.38 115.65 1ibl h ARG 64 Ca 0.50 -0.29 -0.15 0.00 -0.81 0.00 0.00 59.98 59.23 1ibl h ARG 64 Cb 1.59 -0.03 -0.01 0.00 -0.42 0.00 0.00 29.97 31.11 1ibl h ARG 64 CO -0.13 0.88 -0.40 0.82 -1.51 0.00 0.00 179.97 179.63 1ibl h ILE 65 N 0.46 1.28 0.43 1.20 2.04 -0.56 -3.15 117.51 119.22 1ibl h ILE 65 Ca 0.08 -1.58 -0.01 0.00 1.00 0.00 0.00 64.86 64.35 1ibl h ILE 65 Cb 0.66 1.46 -0.03 0.00 -0.74 0.00 0.00 36.82 38.17 1ibl h ILE 65 CO 0.04 0.52 -0.47 0.25 0.00 0.00 0.00 178.15 178.49 1ibl h LEU 66 N 0.66 -1.31 -0.98 1.44 5.85 -1.19 -0.19 115.31 119.59 1ibl h LEU 66 Ca 0.05 0.11 0.30 0.00 0.84 0.00 0.00 57.88 59.19 1ibl h LEU 66 Cb 0.97 0.44 -0.18 0.00 0.37 0.00 0.00 40.66 42.26 1ibl h LEU 66 CO 0.09 -0.62 0.18 0.00 -0.34 0.00 0.00 178.44 177.75 1ibl h ALA 67 N -0.69 1.43 0.00 1.25 0.00 -1.43 0.61 119.26 120.43 1ibl h ALA 67 Ca -0.05 0.31 -0.17 0.00 0.00 0.00 0.00 54.91 55.00 1ibl h ALA 67 Cb 0.82 0.50 -0.02 0.00 0.00 0.00 0.00 17.79 19.09 1ibl h ALA 67 CO -0.09 -0.65 -0.83 -0.22 0.00 0.00 0.00 179.25 177.46 1ibl h LYS 68 N 0.03 0.00 0.05 0.00 3.64 -1.40 -2.74 116.57 116.15 1ibl h LYS 68 Ca 0.66 0.00 -0.00 0.00 -1.27 0.00 0.00 60.65 60.03 1ibl h LYS 68 Cb 1.47 0.00 0.00 0.00 -0.41 0.00 0.00 32.23 33.29 1ibl h LYS 68 CO -0.86 0.82 -0.02 1.15 -2.27 0.00 0.00 179.45 178.27 1ibl h THR 69 N 0.00 1.31 -0.82 1.00 2.02 0.19 -2.73 112.91 113.88 1ibl h THR 69 Ca -0.01 -1.30 0.16 0.00 0.77 0.00 0.00 66.41 66.03 1ibl h THR 69 Cb 1.63 2.15 -0.10 0.00 -1.74 0.00 0.00 68.15 70.09 1ibl h THR 69 CO 0.11 0.32 0.37 0.40 0.37 0.00 0.00 175.52 177.09 1ibl h ILE 70 N -0.65 0.65 0.00 3.11 2.04 -0.70 0.34 117.51 122.31 1ibl h ILE 70 Ca -0.01 -0.17 -0.01 0.00 1.00 0.00 0.00 64.86 65.67 1ibl h ILE 70 Cb 0.57 0.10 -0.00 0.00 -0.74 0.00 0.00 36.82 36.75 1ibl h ILE 70 CO 0.01 0.09 -0.06 0.11 0.00 0.00 0.00 178.15 178.30 1ibl h LYS 71 N 0.51 0.00 -0.03 2.37 1.57 -1.45 -0.66 116.57 118.88 1ibl h LYS 71 Ca 0.46 0.00 -0.10 0.00 -1.87 0.00 0.00 60.65 59.14 1ibl h LYS 71 Cb 0.72 0.00 0.01 0.00 0.08 0.00 0.00 32.23 33.03 1ibl h LYS 71 CO -0.41 0.06 -0.38 0.00 -0.57 0.00 0.00 179.45 178.15 1ibl h ARG 72 N 0.00 0.32 -0.33 3.15 3.08 -0.03 -3.07 114.38 117.50 1ibl h ARG 72 Ca -0.00 -0.30 0.01 0.00 0.07 0.00 0.00 59.98 59.76 1ibl h ARG 72 Cb 0.13 0.07 -0.02 0.00 0.08 0.00 0.00 29.97 30.24 1ibl h ARG 72 CO 0.01 0.97 0.19 0.00 -1.07 0.00 0.00 179.97 180.07 1ibl h ALA 73 N 0.35 0.41 -0.61 0.04 0.00 -0.82 -2.45 119.26 116.19 1ibl h ALA 73 Ca -0.04 -0.01 0.13 0.00 0.00 0.00 0.00 54.91 54.99 1ibl h ALA 73 Cb 1.08 -0.09 -0.10 0.00 0.00 0.00 0.00 17.79 18.68 1ibl h ALA 73 CO 0.08 -0.16 0.00 0.00 0.00 0.00 0.00 179.25 179.17 1ibl h ARG 74 N 0.40 0.12 -0.55 0.00 3.08 -1.18 0.45 114.38 116.70 1ibl h ARG 74 Ca 0.13 -0.01 -0.03 0.00 0.07 0.00 0.00 59.98 60.14 1ibl h ARG 74 Cb -0.00 -0.03 -0.03 0.00 0.08 0.00 0.00 29.97 30.00 1ibl h ARG 74 CO -0.06 0.08 0.22 0.82 -1.07 0.00 0.00 179.97 179.96 1ibl h ILE 75 N 0.12 1.20 0.00 2.04 2.04 -1.35 0.15 117.51 121.70 1ibl h ILE 75 Ca 0.32 -0.62 0.00 0.00 1.00 0.00 0.00 64.86 65.56 1ibl h ILE 75 Cb 0.51 0.55 0.00 0.00 -0.74 0.00 0.00 36.82 37.14 1ibl h ILE 75 CO -0.52 0.24 0.00 0.18 0.00 0.00 0.00 178.15 178.06 1ibl n LEU 76 N -4.34 0.00 -0.09 1.44 4.77 -0.05 -4.88 117.00 113.85 1ibl n LEU 76 Ca 0.04 0.39 -0.01 0.00 -0.03 0.00 0.00 56.01 56.40 1ibl n LEU 76 Cb 0.16 -0.39 -0.00 0.00 -2.33 0.00 0.00 43.42 40.86 1ibl n LEU 76 CO 0.38 -0.10 -0.01 0.61 -1.33 0.00 0.00 177.39 176.94 1ibl n GLY 77 N 0.67 0.41 0.11 -0.72 0.00 0.51 -4.93 105.19 101.24 1ibl n GLY 77 Ca 0.08 -0.97 -0.16 0.00 0.00 0.00 0.00 46.02 44.97 1ibl n GLY 77 CO 0.00 0.00 0.00 1.41 0.00 0.00 0.00 173.32 174.73 1ibl h LEU 78 N 0.00 0.27 -9.06 0.99 3.38 -1.49 -3.47 115.31 105.92 1ibl h LEU 78 Ca -0.02 -0.54 -0.66 0.00 0.09 0.00 0.00 57.88 56.75 1ibl h LEU 78 Cb 0.43 -0.09 -0.18 0.00 0.09 0.00 0.00 40.66 40.91 1ibl h LEU 78 CO 0.03 1.48 -0.82 -0.76 0.09 0.00 0.00 178.44 178.46 1ibl s LEU 79 N -6.70 2.48 0.81 1.67 1.43 -1.25 -4.96 118.68 112.17 1ibl s LEU 79 Ca -0.13 -0.83 -0.12 0.00 -1.03 0.00 0.00 54.13 52.02 1ibl s LEU 79 Cb 0.07 -1.23 0.08 0.00 0.03 0.00 0.00 46.19 45.15 1ibl s LEU 79 CO 0.81 0.12 1.15 -2.16 0.23 0.00 0.00 176.35 176.50 1ibl s PRO 80 N -2.64 1.94 -0.18 1.29 0.04 -1.26 -4.12 135.00 130.08 1ibl s PRO 80 Ca 0.21 0.27 0.14 0.00 0.04 0.00 0.00 61.00 61.67 1ibl s PRO 80 Cb -0.08 -1.93 -0.21 0.00 0.04 0.00 0.00 34.50 32.31 1ibl s PRO 80 CO 0.10 -1.64 0.04 1.19 0.04 0.00 0.00 177.00 176.73 1ibl n PHE 81 N -3.38 0.00 -3.57 0.56 3.01 -1.26 -4.84 117.46 107.98 1ibl n PHE 81 Ca 0.07 0.00 -0.16 0.00 1.01 0.00 0.00 57.45 58.37 1ibl n PHE 81 Cb 0.59 -0.88 -0.06 0.00 -0.01 0.00 0.00 39.48 39.12 1ibl n PHE 81 CO 0.00 0.00 0.00 -0.08 1.01 0.00 0.00 176.76 177.69 1ibl s THR 82 N -2.43 0.00 0.36 4.37 -1.32 -1.26 -4.44 115.64 110.92 1ibl s THR 82 Ca -0.11 0.00 0.08 0.00 -1.21 0.00 0.00 61.69 60.45 1ibl s THR 82 Cb 0.06 -1.00 -0.07 0.00 -1.51 0.00 0.00 72.50 69.98 1ibl s THR 82 CO 0.71 0.00 -0.05 -1.61 -2.21 0.00 0.00 174.62 171.47 1ibl s GLU 83 N -0.52 1.84 -0.18 7.08 0.41 -1.26 -4.60 118.70 121.46 1ibl s GLU 83 Ca -0.06 -1.99 -0.13 0.00 -0.41 0.00 0.00 54.97 52.37 1ibl s GLU 83 Cb -0.02 -1.59 -0.05 0.00 -1.78 0.00 0.00 34.13 30.69 1ibl s GLU 83 CO 0.06 0.04 0.28 0.15 -0.49 0.00 0.00 175.26 175.31 1ibl s LYS 84 N -3.67 4.22 -0.12 1.61 1.02 -1.26 -4.73 119.74 116.81 1ibl s LYS 84 Ca 0.33 0.04 -0.30 0.00 0.02 0.00 0.00 55.97 56.07 1ibl s LYS 84 Cb 0.06 -3.46 -0.02 0.00 -0.52 0.00 0.00 37.83 33.89 1ibl s LYS 84 CO 0.17 0.17 1.22 -1.17 -0.92 0.00 0.00 175.35 174.82 1ibl s LEU 85 N 0.68 4.22 0.64 3.17 0.20 -1.26 -4.96 118.68 121.37 1ibl s LEU 85 Ca 0.15 1.73 0.02 0.00 0.69 0.00 0.00 54.13 56.73 1ibl s LEU 85 Cb -0.13 -3.55 0.09 0.00 -0.43 0.00 0.00 46.19 42.17 1ibl s LEU 85 CO 0.04 -0.67 0.88 -0.69 -0.29 0.00 0.00 176.35 175.62 1ibl s VAL 86 N 2.89 2.30 0.00 1.68 1.01 -1.26 -4.95 120.40 122.07 1ibl s VAL 86 Ca 0.55 -0.72 0.00 0.00 0.00 0.00 0.00 61.98 61.81 1ibl s VAL 86 Cb -0.23 -2.58 0.00 0.00 0.00 0.00 0.00 36.38 33.57 1ibl s VAL 86 CO 0.18 0.00 0.00 0.54 0.00 0.00 0.00 175.10 175.82 1ibl n ARG 87 N -2.55 0.00 -0.85 2.72 5.12 -1.26 -5.24 116.66 114.60 1ibl n ARG 87 Ca 0.13 0.00 0.00 0.00 -1.93 0.00 0.00 57.85 56.05 1ibl n ARG 87 Cb 0.60 0.00 0.00 0.00 -1.16 0.00 0.00 32.46 31.90 1ibl n ARG 87 CO 0.00 0.00 0.00 1.17 -1.93 0.00 0.00 177.63 176.87